4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide

C22H22N2O4 — CID 18085849

IUPAC4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide
SMILESCOc1ccc(C(N)=O)c(OCC(=O)NC(C)c2ccc3ccccc3c2)c1
InChIInChI=1S/C22H22N2O4/c1-14(16-8-7-15-5-3-4-6-17(15)11-16)24-21(25)13-28-20-12-18(27-2)9-10-19(20)22(23)26/h3-12,14H,13H2,1-2H3,(H2,23,26)(H,24,25)
InChIKeyMVJFSNRONGFWHP-UHFFFAOYSA-N
MW378.43 g/mol
LogP3.20
Rot. Bonds7

About 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide

4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide (PubChem CID 18085849) has the molecular formula C22H22N2O4 and a molecular weight of 378.43 g/mol. Its IUPAC name is 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide
PubChem CID18085849
Molecular FormulaC22H22N2O4
Molecular Weight378.43 g/mol
Exact Mass378.16
IUPAC Name4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide
SMILESCOc1ccc(C(N)=O)c(OCC(=O)NC(C)c2ccc3ccccc3c2)c1
InChIInChI=1S/C22H22N2O4/c1-14(16-8-7-15-5-3-4-6-17(15)11-16)24-21(25)13-28-20-12-18(27-2)9-10-19(20)22(23)26/h3-12,14H,13H2,1-2H3,(H2,23,26)(H,24,25)
InChIKeyMVJFSNRONGFWHP-UHFFFAOYSA-N
XLogP3.20
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[1-(3,4-dimethylphenyl)ethylamino]-2-oxoethoxy]-4-methoxybenzamide
CID 24527523
2-(3-methoxyphenoxy)-N-(1-naphthalen-2-ylethyl)acetamide
CID 112779282
2-(3,5-dimethoxyphenoxy)-N-[(1R)-1-naphthalen-2-ylethyl]acetamide
CID 7714005
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide
CID 94843861
N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide
CID 7899710
2-(4-methoxyphenyl)-N-[(1S)-1-naphthalen-2-ylethyl]acetamide
CID 974464
2-methoxy-N-(1-naphthalen-2-ylethyl)acetamide
CID 43011314
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(2-methylphenoxy)acetamide
CID 94843850
N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-2-naphthalen-1-yloxyacetamide
CID 92679204
2-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethoxy]benzamide
CID 8866061
2-(4-methylsulfanylphenoxy)-N-(1-naphthalen-2-ylethyl)acetamide
CID 42900557
[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2,4-dimethoxybenzoate
CID 2505113

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide?
The IUPAC name of 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide (CID 18085849) is 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide.
What is the SMILES notation for 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide?
The canonical SMILES for 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide is COc1ccc(C(N)=O)c(OCC(=O)NC(C)c2ccc3ccccc3c2)c1.
What is the InChIKey of 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide?
The InChIKey is MVJFSNRONGFWHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4/c1-14(16-8-7-15-5-3-4-6-17(15)11-16)24-21(25)13-28-20-12-18(27-2)9-10-19(20)22(23)26/h3-12,14H,13H2,1-2H3,(H2,23,26)(H,24,25).
What are the key properties of 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide?
4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide has a molecular weight of 378.43 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[2-(1-naphthalen-2-ylethylamino)-2-oxoethoxy]benzamide is sourced from PubChem (CID 18085849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).